| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60204300 |
Structure
| InChI Key | WEBVDBDZSOJGPB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H8O2 |
| Molecular Weight | 148.05 |
| AlogP | 1.43 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 55745-70-5 |
| NORMAN SUSDAT | |
| PubChem | 735901 |
| ChemSpider | 643047.0 |
CONTENTS
